2-[2-[(2,4-dichlorophenyl)methylsulfanyl]ethanoylamino]-5-iodanyl-benzoic acid

Systemtic Name: 2-[2-[(2,4-dichlorophenyl)methylsulfanyl]ethanoylamino]-5-iodanyl-benzoic acid Openeye Name: 2-[[2-[(2,4-dichlorophenyl)methylsulfanyl]acetyl]amino]-5-iodo-benzoic acid CAS Name: 2-[[2-[(2,4-dichlorophenyl)methylthio]-1-oxoethyl]amino]-5-iodobenzoic acid IUPAC Name: 2-[[2-[(2,4-dichlorophenyl)methylsulfanyl]acetyl]amino]-5-iodobenzoic acid Traditional Name: 2-[[2-[(2,4-dichlorobenzyl)thio]acetyl]amino]-5-iodo-benzoic acid Formula: C16H12Cl2INO3S MolecularWeight: 496.14685

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)CSCC(=O)NC2=C(C=C(C=C2)I)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)CSCC(=O)NC2=C(C=C(C=C2)I)C(=O)O

InChI

InChI=1S/C16H12Cl2INO3S/c17-10-2-1-9(13(18)5-10)7-24-8-15(21)20-14-4-3-11(19)6-12(14)16(22)23/h1-6H,7-8H2,(H,20,21)(H,22,23)